SCHEMBL12222857

SCHEMBL12222857

CCC(O)c1ccc(-c2ccc(OCC3CCC(C4CCC(c5ccc(C6CO6)c(F)c5F)CC4)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 7/20 0.34
▸ FPR2 P25090 3/20 0.32
▸ FEN1 P39748 3/20 0.32
▸ ALOX5AP P20292 2/20 0.32
▸ PDE4B Q07343 1/20 0.31
▸ SSTR5 P35346 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12836512 0.97 CNR2 (0.36) CNR2FPR2FEN1ALOX5APPDE4B
SCHEMBL12836054 0.97 CNR2 (0.36) CNR2FPR2FEN1ALOX5APPDE4B
SCHEMBL12223313 0.91 ALOX5AP (0.33) CNR2FPR2FEN1ALOX5AP
SCHEMBL12836495 0.90 CNR2 (0.33) CNR2FPR2FEN1ALOX5AP
SCHEMBL12836038 0.90 CNR2 (0.33) CNR2FPR2FEN1ALOX5AP
SCHEMBL11939167 0.90 CNR2 (0.39) CNR2FEN1ALOX5APSSTR5KCNH2
SCHEMBL11939058 0.90 CNR2 (0.39) CNR2FEN1ALOX5APSSTR5KCNH2
SCHEMBL12836034 0.88 FEN1 (0.34) CNR2FPR2FEN1ALOX5AP
SCHEMBL12836492 0.88 FEN1 (0.34) CNR2FPR2FEN1ALOX5AP
SCHEMBL12222880 0.87 GPR119 (0.34) FEN1ALOX5AP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-10-06 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NCAPD3, CCND3, ZKSCAN2 CNR2 253/4885FPR2 1970/4885FEN1 3903/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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